Unclassified Organic Compounds

Organic compounds that do not fit into any other organic chemical classification.

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1,051 – 1,065 of 202,914 results

1,051

Benzopurpurin 4B

CAS: 992-59-6 Molecular Formula: C34H26N6Na2O6S2 Molecular Weight (g/mol): 724.718 MDL Number: MFCD00012410 InChI Key: SUXCALIDMIIJCK-UHFFFAOYSA-L Synonym: benzopurpurine 4b,benzopurpurin 4b,direct red 2,c.i. direct red 2,amanil purpurine,diphenyl red 4b,hispamin red 4b,direct red dcb,azocard red 4b,diazine red 4b PubChem CID: 13816 IUPAC Name: disodium;4-amino-3-[[4-[4-[(1-amino-4-sulfonatonaphthalen-2-yl)diazenyl]-3-methylphenyl]-2-methylphenyl]diazenyl]naphthalene-1-sulfonate SMILES: CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC3=C(C4=CC=CC=C4C(=C3)S(=O)(=O)[O-])N)C)N=NC5=C(C6=CC=CC=C6C(=C5)S(=O)(=O)[O-])N.[Na+].[Na+]

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Specifications

PubChem CID	13816
CAS	992-59-6
Molecular Weight (g/mol)	724.718
MDL Number	MFCD00012410
SMILES	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC3=C(C4=CC=CC=C4C(=C3)S(=O)(=O)[O-])N)C)N=NC5=C(C6=CC=CC=C6C(=C5)S(=O)(=O)[O-])N.[Na+].[Na+]
Synonym	benzopurpurine 4b,benzopurpurin 4b,direct red 2,c.i. direct red 2,amanil purpurine,diphenyl red 4b,hispamin red 4b,direct red dcb,azocard red 4b,diazine red 4b
IUPAC Name	disodium;4-amino-3-[[4-[4-[(1-amino-4-sulfonatonaphthalen-2-yl)diazenyl]-3-methylphenyl]-2-methylphenyl]diazenyl]naphthalene-1-sulfonate
InChI Key	SUXCALIDMIIJCK-UHFFFAOYSA-L
Molecular Formula	C34H26N6Na2O6S2

1,052

Glassy carbon splinter powder, 2000 to 3150μm, type 1, Thermo Scientific™

MDL Number: MFCD00133992

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Specifications

MDL Number	MFCD00133992

1,053

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(+/-)-Boc-alpha-phosphonoglycine trimethyl ester, 95%

CAS: 89524-98-1 Molecular Formula: C10H20NO7P Molecular Weight (g/mol): 297.24 MDL Number: MFCD02178893 InChI Key: LJHAPRKTPAREGO-ZETCQYMHSA-N Synonym: methyl 2-tert-butoxycarbonyl amino-2-dimethoxyphosphoryl acetate,+/--boc-alpha-phosphonoglycine trimethyl ester,n-boc-2-phosphonoglycine trimethyl ester,methyl n-boc-2-dimethylphosphono glycinate,methyl 2-tert-butoxycarbonylamino-2-dimethoxyphosphoryl-acetate,boc-alpha-phosphonoglycine trimethyl ester,n-butoxycarbonyl trimethylphosphonoglycine,methyl 2-tert-butoxy carbonyl amino-2-dimethoxyphosphoryl acetate,boc-a-phosphonoglycine trimethyl ester,boc-?-phosphonoglycine trimethyl ester PubChem CID: 397380 IUPAC Name: methyl 2-dimethoxyphosphoryl-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetate SMILES: COC(=O)[C@@H](NC(=O)OC(C)(C)C)P(=O)(OC)OC

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Specifications

PubChem CID	397380
CAS	89524-98-1
Molecular Weight (g/mol)	297.24
MDL Number	MFCD02178893
SMILES	COC(=O)[C@@H](NC(=O)OC(C)(C)C)P(=O)(OC)OC
Synonym	methyl 2-tert-butoxycarbonyl amino-2-dimethoxyphosphoryl acetate,+/--boc-alpha-phosphonoglycine trimethyl ester,n-boc-2-phosphonoglycine trimethyl ester,methyl n-boc-2-dimethylphosphono glycinate,methyl 2-tert-butoxycarbonylamino-2-dimethoxyphosphoryl-acetate,boc-alpha-phosphonoglycine trimethyl ester,n-butoxycarbonyl trimethylphosphonoglycine,methyl 2-tert-butoxy carbonyl amino-2-dimethoxyphosphoryl acetate,boc-a-phosphonoglycine trimethyl ester,boc-?-phosphonoglycine trimethyl ester
IUPAC Name	methyl 2-dimethoxyphosphoryl-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetate
InChI Key	LJHAPRKTPAREGO-ZETCQYMHSA-N
Molecular Formula	C10H20NO7P

1,054

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D-(-)-Prolinamide, 98%

CAS: 62937-45-5 Molecular Formula: C5H10N2O Molecular Weight (g/mol): 114.15 MDL Number: MFCD00153457 InChI Key: VLJNHYLEOZPXFW-UHFFFAOYNA-N Synonym: d-prolinamide,r-prolinamide,h-d-pro-nh2,r-pyrrolidine-2-carboxamide,2r-pyrrolidine-2-carboxamide,d-proline amide,h-d-pro-nh,d-pro-nh2,2r-2-carbamoylpyrrolidine,2-pyrrolidinecarboxamide, 2r PubChem CID: 447554 IUPAC Name: (2R)-pyrrolidine-2-carboxamide SMILES: NC(=O)C1CCCN1

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Specifications

PubChem CID	447554
CAS	62937-45-5
Molecular Weight (g/mol)	114.15
MDL Number	MFCD00153457
SMILES	NC(=O)C1CCCN1
Synonym	d-prolinamide,r-prolinamide,h-d-pro-nh2,r-pyrrolidine-2-carboxamide,2r-pyrrolidine-2-carboxamide,d-proline amide,h-d-pro-nh,d-pro-nh2,2r-2-carbamoylpyrrolidine,2-pyrrolidinecarboxamide, 2r
IUPAC Name	(2R)-pyrrolidine-2-carboxamide
InChI Key	VLJNHYLEOZPXFW-UHFFFAOYNA-N
Molecular Formula	C5H10N2O

1,055

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1,1'-Biadamantane, Thermo Scientific Chemicals

CAS: 3732-31-8 Molecular Formula: C20H30 Molecular Weight (g/mol): 270.46 MDL Number: MFCD01910632 InChI Key: MPXKIFWZOQVOLN-UHFFFAOYSA-N Synonym: 1,1 '-Diadamantane; Bisadamantane IUPAC Name: 1,1'-biadamantane SMILES: C1C2CC3CC1CC(C2)(C3)C12CC3CC(CC(C3)C1)C2

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Specifications

CAS	3732-31-8
Molecular Weight (g/mol)	270.46
MDL Number	MFCD01910632
SMILES	C1C2CC3CC1CC(C2)(C3)C12CC3CC(CC(C3)C1)C2
Synonym	1,1 '-Diadamantane; Bisadamantane
IUPAC Name	1,1'-biadamantane
InChI Key	MPXKIFWZOQVOLN-UHFFFAOYSA-N
Molecular Formula	C20H30

1,056

Petroleum ether, pure, boiling range ca. 180-280°C

CAS: 8008-20-6 MDL Number: MFCD00135561

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Specifications

CAS	8008-20-6
MDL Number	MFCD00135561

1,057

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o-Tolylmagnesium bromide, 2M solution in diethyl ether, AcroSeal™, Thermo Scientific Chemicals

CAS: 932-31-0 Molecular Formula: C7H7BrMg Molecular Weight (g/mol): 195.34 MDL Number: MFCD00010350 InChI Key: DVXDIGKNJYSMFM-UHFFFAOYSA-M Synonym: o-tolylmagnesium bromide,bromo-o-tolylmagnesium,bromo 2-methylphenyl magnesium,2-tolylmagnesium bromide,o-methylphenylmagnesium bromide,2-methylphenylmagnesium bromide,magnesium,bromo 2-methylphenyl,o-tolyl magnesium bromide,tolylmagnesium bromide,o-tolylmagnesiumbromid,grignard reagent PubChem CID: 101919 IUPAC Name: magnesium;methylbenzene;bromide SMILES: CC1=CC=CC=C1[Mg]Br

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Specifications

PubChem CID	101919
CAS	932-31-0
Molecular Weight (g/mol)	195.34
MDL Number	MFCD00010350
SMILES	CC1=CC=CC=C1[Mg]Br
Synonym	o-tolylmagnesium bromide,bromo-o-tolylmagnesium,bromo 2-methylphenyl magnesium,2-tolylmagnesium bromide,o-methylphenylmagnesium bromide,2-methylphenylmagnesium bromide,magnesium,bromo 2-methylphenyl,o-tolyl magnesium bromide,tolylmagnesium bromide,o-tolylmagnesiumbromid,grignard reagent
IUPAC Name	magnesium;methylbenzene;bromide
InChI Key	DVXDIGKNJYSMFM-UHFFFAOYSA-M
Molecular Formula	C7H7BrMg

1,058

17-(Allylamino)-17-demethoxygeldanamycin, 99%

CAS: 75747-14-7 Molecular Formula: C31H43N3O8 Molecular Weight (g/mol): 585.698 MDL Number: MFCD04973892 InChI Key: AYUNIORJHRXIBJ-MKJFUHJFSA-N Synonym: 17-aag PubChem CID: 133688938 IUPAC Name: [(3S,5R,6S,7R,8Z,11R,14E)-6-hydroxy-5,11-dimethoxy-3,7,9,15-tetramethyl-16,20,22-trioxo-21-(prop-2-enylamino)-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] carbamate SMILES: CC1CC(C(C(C=C(C(C(C=CC=C(C(=O)NC2=CC(=O)C(=C(C1)C2=O)NCC=C)C)OC)OC(=O)N)C)C)O)OC

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Specifications

PubChem CID	133688938
CAS	75747-14-7
Molecular Weight (g/mol)	585.698
MDL Number	MFCD04973892
SMILES	CC1CC(C(C(C=C(C(C(C=CC=C(C(=O)NC2=CC(=O)C(=C(C1)C2=O)NCC=C)C)OC)OC(=O)N)C)C)O)OC
Synonym	17-aag
IUPAC Name	[(3S,5R,6S,7R,8Z,11R,14E)-6-hydroxy-5,11-dimethoxy-3,7,9,15-tetramethyl-16,20,22-trioxo-21-(prop-2-enylamino)-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] carbamate
InChI Key	AYUNIORJHRXIBJ-MKJFUHJFSA-N
Molecular Formula	C31H43N3O8

1,059

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N-Boc-trans-4-hydroxy-L-proline methyl ester, 97%

CAS: 74844-91-0 Molecular Formula: C11H19NO5 Molecular Weight (g/mol): 245.28 MDL Number: MFCD00076981 InChI Key: MZMNEDXVUJLQAF-SFYZADRCSA-N Synonym: boc-hyp-ome,n-boc-trans-4-hydroxy-l-proline methyl ester,2s,4r-1-tert-butyl 2-methyl 4-hydroxypyrrolidine-1,2-dicarboxylate,1-tert-butyl 2-methyl 2s,4r-4-hydroxypyrrolidine-1,2-dicarboxylate,boc-l-hydroxyproline methyl ester,boc-hydroxyproline-ome,methyl trans-1-boc-4-hydroxy-l-prolinate,n-tert-butoxycarbonyl-trans-4-hydroxy-l-proline methyl ester,trans-1-tert-butoxycarbonyl-4-hydroxy-l-proline methyl ester,n-boc-trans-4-hydroxyl-l-proline methyl ester PubChem CID: 2734883 SMILES: COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C

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Specifications

PubChem CID	2734883
CAS	74844-91-0
Molecular Weight (g/mol)	245.28
MDL Number	MFCD00076981
SMILES	COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C
Synonym	boc-hyp-ome,n-boc-trans-4-hydroxy-l-proline methyl ester,2s,4r-1-tert-butyl 2-methyl 4-hydroxypyrrolidine-1,2-dicarboxylate,1-tert-butyl 2-methyl 2s,4r-4-hydroxypyrrolidine-1,2-dicarboxylate,boc-l-hydroxyproline methyl ester,boc-hydroxyproline-ome,methyl trans-1-boc-4-hydroxy-l-prolinate,n-tert-butoxycarbonyl-trans-4-hydroxy-l-proline methyl ester,trans-1-tert-butoxycarbonyl-4-hydroxy-l-proline methyl ester,n-boc-trans-4-hydroxyl-l-proline methyl ester
InChI Key	MZMNEDXVUJLQAF-SFYZADRCSA-N
Molecular Formula	C11H19NO5

1,060

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N-Fmoc-4-iodo-L-phenylalanine, 95%

CAS: 82565-68-2 Molecular Formula: C24H20INO4 Molecular Weight (g/mol): 513.33 MDL Number: MFCD00672340 InChI Key: LXOXXTQKKRJNNB-QFIPXVFZSA-N Synonym: fmoc-4-iodo-l-phenylalanine,fmoc-phe 4-i-oh,fmoc-l-4-iodophenylalanine,fmoc-l-phe 4-i-oh,fmoc-p-iodo-phe-oh,fmoc-4'-iodo-l-phe,s-2-9h-fluoren-9-yl methoxy carbonyl amino-3-4-iodophenyl propanoic acid,fmoc-l-phe 4-i,2s-2-9h-fluoren-9-ylmethoxycarbonylamino-3-4-iodophenyl propanoic acid,l-phenylalanine, n-9h-fluoren-9-ylmethoxy carbonyl-4-iodo PubChem CID: 2761479 SMILES: OC(=O)[C@H](CC1=CC=C(I)C=C1)NC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12

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Specifications

PubChem CID	2761479
CAS	82565-68-2
Molecular Weight (g/mol)	513.33
MDL Number	MFCD00672340
SMILES	OC(=O)[C@H](CC1=CC=C(I)C=C1)NC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12
Synonym	fmoc-4-iodo-l-phenylalanine,fmoc-phe 4-i-oh,fmoc-l-4-iodophenylalanine,fmoc-l-phe 4-i-oh,fmoc-p-iodo-phe-oh,fmoc-4'-iodo-l-phe,s-2-9h-fluoren-9-yl methoxy carbonyl amino-3-4-iodophenyl propanoic acid,fmoc-l-phe 4-i,2s-2-9h-fluoren-9-ylmethoxycarbonylamino-3-4-iodophenyl propanoic acid,l-phenylalanine, n-9h-fluoren-9-ylmethoxy carbonyl-4-iodo
InChI Key	LXOXXTQKKRJNNB-QFIPXVFZSA-N
Molecular Formula	C24H20INO4

1,061

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N-Acetyl-L-tyrosine ethyl ester monohydrate, 99%

CAS: 36546-50-6 Molecular Formula: C13H19NO5 Molecular Weight (g/mol): 269.30 MDL Number: MFCD00149093 InChI Key: YWAVLHZJMWEYTA-HVPILOLGNA-N Synonym: n-acetyl-l-tyrosine ethyl ester monohydrate,ethyl n-acetyl-l-tyrosinate hydrate,ac-tyr-oet.h2o,atee,ethyl 2s-2-acetamido-3-4-hydroxyphenyl propanoate hydrate,n-acetyl-l-tyrosineethylestermonohydrate,n-acetyltyrosine ethyl ester monohydrate,ksc491m4n,n-acetyl tyrosine ethyl ester mono hydrate,acetyl-l-tyrosine ethyl ester hydrate PubChem CID: 2723594 IUPAC Name: ethyl (2S)-2-acetamido-3-(4-hydroxyphenyl)propanoate;hydrate SMILES: O.CCOC(=O)[C@H](CC1=CC=C(O)C=C1)NC(C)=O

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Specifications

PubChem CID	2723594
CAS	36546-50-6
Molecular Weight (g/mol)	269.30
MDL Number	MFCD00149093
SMILES	O.CCOC(=O)[C@H](CC1=CC=C(O)C=C1)NC(C)=O
Synonym	n-acetyl-l-tyrosine ethyl ester monohydrate,ethyl n-acetyl-l-tyrosinate hydrate,ac-tyr-oet.h2o,atee,ethyl 2s-2-acetamido-3-4-hydroxyphenyl propanoate hydrate,n-acetyl-l-tyrosineethylestermonohydrate,n-acetyltyrosine ethyl ester monohydrate,ksc491m4n,n-acetyl tyrosine ethyl ester mono hydrate,acetyl-l-tyrosine ethyl ester hydrate
IUPAC Name	ethyl (2S)-2-acetamido-3-(4-hydroxyphenyl)propanoate;hydrate
InChI Key	YWAVLHZJMWEYTA-HVPILOLGNA-N
Molecular Formula	C13H19NO5

1,062

Iminodiacetic acid disodium salt hydrate, 97%

CAS: 17593-73-6 Molecular Formula: C4H5NNa2O4 Molecular Weight (g/mol): 177.07 MDL Number: MFCD00150689 InChI Key: HAXVIVNBOQIMTE-UHFFFAOYSA-L Synonym: disodium iminodiacetate hydrate,iminodiacetic acid disodium salt hydrate,sodium 2,2'-azanediyldiacetate hydrate,disodium hydrate iminodiacetate,iminodiacetic acid, disodium salt monohydrate,sodium iminodiacetate dibasic hydrate,acmc-209ri5,c4h5no4.2na.h2o,disodium iminodiacetate monohydrate,sodium 2,2-azanediyldiacetate hydrate PubChem CID: 12520792 IUPAC Name: disodium;2-(carboxylatomethylamino)acetate;hydrate SMILES: [Na+].[Na+].[O-]C(=O)CNCC([O-])=O

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Specifications

PubChem CID	12520792
CAS	17593-73-6
Molecular Weight (g/mol)	177.07
MDL Number	MFCD00150689
SMILES	[Na+].[Na+].[O-]C(=O)CNCC([O-])=O
Synonym	disodium iminodiacetate hydrate,iminodiacetic acid disodium salt hydrate,sodium 2,2'-azanediyldiacetate hydrate,disodium hydrate iminodiacetate,iminodiacetic acid, disodium salt monohydrate,sodium iminodiacetate dibasic hydrate,acmc-209ri5,c4h5no4.2na.h2o,disodium iminodiacetate monohydrate,sodium 2,2-azanediyldiacetate hydrate
IUPAC Name	disodium;2-(carboxylatomethylamino)acetate;hydrate
InChI Key	HAXVIVNBOQIMTE-UHFFFAOYSA-L
Molecular Formula	C4H5NNa2O4

1,063

Dichloro[bis(dicyclohexylphosphinophenyl)ether]palladium(II), 98% min, Thermo Scientific™

CAS: 1265140-81-5 Molecular Formula: C36H52Cl2OP2Pd Molecular Weight (g/mol): 740.08 MDL Number: MFCD26967909 InChI Key: UPHBRQDWOFHFER-UHFFFAOYSA-L Synonym: [Bis(dicyclohexylphosphinophenyl)ether]dichloropalladium(II); [Bis(dicyclohexylphosphinophenyl)ether]palladium(II) dichloride PubChem CID: 134159297 IUPAC Name: dichloropalladium;dicyclohexyl-[4-(4-dicyclohexylphosphanylphenoxy)phenyl]phosphane SMILES: Cl[Pd]Cl.C1CCC(CC1)P(C1CCCCC1)C1=CC=C(OC2=CC=C(C=C2)P(C2CCCCC2)C2CCCCC2)C=C1

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Specifications

PubChem CID	134159297
CAS	1265140-81-5
Molecular Weight (g/mol)	740.08
MDL Number	MFCD26967909
SMILES	Cl[Pd]Cl.C1CCC(CC1)P(C1CCCCC1)C1=CC=C(OC2=CC=C(C=C2)P(C2CCCCC2)C2CCCCC2)C=C1
Synonym	[Bis(dicyclohexylphosphinophenyl)ether]dichloropalladium(II); [Bis(dicyclohexylphosphinophenyl)ether]palladium(II) dichloride
IUPAC Name	dichloropalladium;dicyclohexyl-[4-(4-dicyclohexylphosphanylphenoxy)phenyl]phosphane
InChI Key	UPHBRQDWOFHFER-UHFFFAOYSA-L
Molecular Formula	C36H52Cl2OP2Pd

1,064

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4-tert-Butylcyclohexanone, 99%

CAS: 98-53-3 Molecular Formula: C₁₀H₁₈O Molecular Weight (g/mol): 154.25 MDL Number: MFCD00001642 InChI Key: YKFKEYKJGVSEIX-UHFFFAOYSA-N Synonym: 4-tert-butylcyclohexanone,4-tert-butyl cyclohexanone,p-tert-butylcyclohexanone,cyclohexanone, 4-1,1-dimethylethyl,cyclohexanone, p-tert-butyl,cyclohexanone, 4-tert-butyl,4-t-butylcyclohexanone,4-tert-butyl cyclohexan-1-one,.gamma.-tert-butylcyclohexanone,pubchem20244 PubChem CID: 7392 IUPAC Name: 4-tert-butylcyclohexan-1-one SMILES: CC(C)(C)C1CCC(=O)CC1

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Specifications

PubChem CID	7392
CAS	98-53-3
Molecular Weight (g/mol)	154.25
MDL Number	MFCD00001642
SMILES	CC(C)(C)C1CCC(=O)CC1
Synonym	4-tert-butylcyclohexanone,4-tert-butyl cyclohexanone,p-tert-butylcyclohexanone,cyclohexanone, 4-1,1-dimethylethyl,cyclohexanone, p-tert-butyl,cyclohexanone, 4-tert-butyl,4-t-butylcyclohexanone,4-tert-butyl cyclohexan-1-one,.gamma.-tert-butylcyclohexanone,pubchem20244
IUPAC Name	4-tert-butylcyclohexan-1-one
InChI Key	YKFKEYKJGVSEIX-UHFFFAOYSA-N
Molecular Formula	C₁₀H₁₈O

1,065

N1-(2-Chlorophenyl)-2-bromoacetamide, 95%, Thermo Scientific™

CAS: 5439-11-2 Molecular Formula: C8H7BrClNO Molecular Weight (g/mol): 248.50 MDL Number: MFCD00173815 InChI Key: WIOJXHICOOQVAB-UHFFFAOYSA-N Synonym: 2-bromo-n-2-chlorophenyl acetamide,n1-2-chlorophenyl-2-bromoacetamide,n-bromoacetyl-2'-chloroacetaniline,wiojxhicooqvab-uhfffaoysa-n,2-bromo-n-2-chloro-phenyl-acetamide,acetamide, 2-bromo-n-2-chlorophenyl PubChem CID: 225525

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Specifications

PubChem CID	225525
CAS	5439-11-2
Molecular Weight (g/mol)	248.50
MDL Number	MFCD00173815
Synonym	2-bromo-n-2-chlorophenyl acetamide,n1-2-chlorophenyl-2-bromoacetamide,n-bromoacetyl-2'-chloroacetaniline,wiojxhicooqvab-uhfffaoysa-n,2-bromo-n-2-chloro-phenyl-acetamide,acetamide, 2-bromo-n-2-chlorophenyl
InChI Key	WIOJXHICOOQVAB-UHFFFAOYSA-N
Molecular Formula	C8H7BrClNO

Unclassified Organic Compounds

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